(4-butoxyphenyl) 4-(2-fluoranylsulfanyldecoxy)benzoate

Systemtic Name: (4-butoxyphenyl) 4-(2-fluoranylsulfanyldecoxy)benzoate Openeye Name: (4-butoxyphenyl) 4-(2-fluorosulfanyldecoxy)benzoate CAS Name: 4-[2-(fluorothio)decoxy]benzoic acid (4-butoxyphenyl) ester IUPAC Name: (4-butoxyphenyl) 4-(2-fluorosulfanyldecoxy)benzoate Traditional Name: 4-[2-(fluorothio)decoxy]benzoic acid (4-butoxyphenyl) ester Formula: C27H37FO4S MolecularWeight: 476.643683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCC)SF

Isomeric SMILES

CCCCCCCCC(COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCC)SF

InChI

InChI=1S/C27H37FO4S/c1-3-5-7-8-9-10-11-26(33-28)21-31-24-14-12-22(13-15-24)27(29)32-25-18-16-23(17-19-25)30-20-6-4-2/h12-19,26H,3-11,20-21H2,1-2H3